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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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Analogs

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Popular Name: 2-[(5-butylamino-1,3,4-thiadiazol-2-yl)sulfanylmethyl]furan-3-carboxylic 2-[(5-butylamino-1,3,4-thiadiazo…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.02 5.86 -55.17 1 6 -1 91 312.396 8 ↓

Analogs

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Popular Name: 2-[[5-(2-methoxyethylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]furan-3-carboxylic 2-[[5-(2-methoxyethylamino)-1,3,…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.57 3.4 -55.88 1 7 -1 100 314.368 8 ↓

Analogs

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Popular Name: 2-[(5-propylamino-1,3,4-thiadiazol-2-yl)sulfanylmethyl]furan-3-carboxylic 2-[(5-propylamino-1,3,4-thiadiaz…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.46 5.09 -55.39 1 6 -1 91 298.369 7 ↓

Analogs

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Popular Name: 2-[(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]furan-3-carboxylic 2-[(5-propylsulfanyl-1,3,4-thiad…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.20 6.1 -53.1 0 5 -1 79 315.421 7 ↓

Analogs

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Popular Name: 2-[(5-ethylamino-1,3,4-thiadiazol-2-yl)sulfanylmethyl]furan-3-carboxylic 2-[(5-ethylamino-1,3,4-thiadiazo…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.96 4.32 -55.59 1 6 -1 91 284.342 6 ↓

Analogs

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Popular Name: 2-[[5-(isobutylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]furan-3-carboxylic 2-[[5-(isobutylamino)-1,3,4-thia…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.71 5.8 -55.08 1 6 -1 91 312.396 7 ↓

Analogs

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Popular Name: 2-[[5-(sec-butylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]furan-3-carboxylic 2-[[5-(sec-butylamino)-1,3,4-thi…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.79 5.98 -55.88 1 6 -1 91 312.396 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[5-(sec-butylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]furan-3-carboxylic 2-[[5-(sec-butylamino)-1,3,4-thi…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.79 5.98 -55.86 1 6 -1 91 312.396 7 ↓

Analogs

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Popular Name: 2-[[5-(tert-butylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]furan-3-carboxylic 2-[[5-(tert-butylamino)-1,3,4-th…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.77 5.62 -55.99 1 6 -1 91 312.396 6 ↓

Analogs

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Popular Name: 2-[[5-(allylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]furan-3-carboxylic 2-[[5-(allylamino)-1,3,4-thiadia…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.23 4.87 -55.19 1 6 -1 91 296.353 7 ↓

Analogs

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Popular Name: 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanylmethyl]furan-3-carboxylic 2-[(5-amino-1,3,4-thiadiazol-2-y…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.21 2.53 -55.89 2 6 -1 105 256.288 4 ↓

Analogs

12483346
12483346

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Popular Name: methyl methyl

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.90 5.61 -9.56 0 5 0 65 302.402 6 ↓

Analogs

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Popular Name: methyl methyl

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.25 3.29 -31.87 1 10 0 132 420.494 9 ↓
Hi High (pH 8-9.5) 1.07 1.71 -57.39 0 10 -1 138 419.486 9 ↓

Analogs

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Popular Name: methyl methyl

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.79 3.43 -18.52 2 9 0 116 372.428 9 ↓

Analogs

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Popular Name: N,N-dimethyl-5-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]furan-2-sulfonamide N,N-dimethyl-5-[(5-methyl-1,3,4-…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.42 2.66 -13.93 0 6 0 76 319.433 5 ↓

Parameters Provided:

ring.id = 117932
filter.purchasability = annotated
page.format = targets
page.num = 1

Structural Results Found: (before additional filtering)

SQL Query Was

SELECT DISTINCT(ci.sub_id_fk) AS sub_id FROM catalog_item AS ci INNER JOIN catalog AS c ON ci.cat_id_fk=c.cat_id INNER JOIN hasring AS hr ON ci.sub_id_fk=hr.sub_id_fk INNER JOIN rings AS r ON hr.rings_fk=r.rings_id  WHERE r.rings_id = 117932 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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